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canSAR782297
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NAMES
    SMILES
    COc1ccc(CO[C@H]2CC[C@]3(C)C[C@H](Cc4ccc(C(=O)O)cc4)CCC3C2(C)C)cc1
    InChI
    InChI=1S/C29H38O4/c1-28(2)25-14-9-22(17-20-5-10-23(11-6-20)27(30)31)18-29(25,3)16-15-26(28)33-19-21-7-12-24(32-4)13-8-21/h5-8,10-13,22,25-26H,9,14-19H2,1-4H3,(H,30,31)/t22-,25?,26-,29+/m0/s1
    MOLECULAR FORMULA
    C29H38O4
    CROSS REFERENCES
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    canSAR782297

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.28
    AlogP 6.76
    HBond donors 1
    HBond acceptors 4
    Atoms 71
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR782297.